SCHEMBL1269977

SCHEMBL1269977

Ic1cccc2c(I)cccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 1/20 0.44
DYRK1A Q13627 2/20 0.39
TYMS P04818 2/20 0.38
CYP1A2 P05177 4/20 0.37
CYP2A6 P11509 3/20 0.37
TSHR P16473 3/20 0.37
ALDH1A1 P00352 3/20 0.37
HSD17B10 Q99714 3/20 0.37
CYP3A4 P08684 2/20 0.37
HPGD P15428 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
PLAU P00749 2/20 0.35
F9 P00740 1/20 0.35
F10 P00742 1/20 0.35
TP53 P04637 1/20 0.35
CYP2D6 P10635 1/20 0.35
NFKB1 P19838 1/20 0.35
CYP2C19 P33261 1/20 0.35
MTOR P42345 1/20 0.35
RAB9A P51151 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30608894 1.00 NOS1 (0.44) NOS1DYRK1ATYMSCYP1A2CYP2A6
SCHEMBL22077551 0.85 NOS1 (0.37) NOS1DYRK1ATYMSCYP1A2TSHR
SCHEMBL3193406 0.85 ALDH1A1 (0.39) NOS1CYP1A2CYP2A6TSHRALDH1A1
SCHEMBL29926858 0.85 ALDH1A1 (0.39) NOS1CYP1A2CYP2A6TSHRALDH1A1
SCHEMBL24730214 0.83 CYP1A2 (0.68) NOS1DYRK1ACYP1A2CYP2A6TSHR
SCHEMBL18242598 0.83 TYMS (0.36) NOS1DYRK1ATYMSCYP1A2TSHR
SCHEMBL19070478 0.83 ALDH1A1 (0.68) DYRK1ATYMSTSHRALDH1A1HSD17B10
SCHEMBL13667699 0.83 CYP1A2 (0.68) NOS1TYMSCYP1A2CYP2A6TSHR
SCHEMBL4960075 0.83 IDO1 (0.52) NOS1CYP1A2TSHRALDH1A1HSD17B10
SCHEMBL12005998 0.83 PARP1 (0.48) NOS1DYRK1ATYMSALDH1A1HPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 274 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4063368-B1 NITROGEN-CONTAINING COMPOUND AND ELECTRONIC ELEMENT COMPRISING SAME, AND ELECTRONIC APPARATUS SHAANXI LIGHTE OPTOELECTRONICS MAT CO LTD (CN) 2024-06-26 EP disclosed
CN-118184516-A Preparation method of N1, N5-disubstituted-1, 5-naphthalene diamine compound 台州学院 2024-06-14 CN disclosed
WO-2024122799-A1 COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME 주식회사 엘지화학 2024-06-13 WO disclosed
WO-2024063592-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2024-03-28 WO disclosed
WO-2024043703-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING THE SAME 주식회사 엘지화학 2024-02-29 WO disclosed
CN-115716787-B Alkyl fluorene small molecular compound and preparation method and application thereof 天津大学 2024-02-13 CN disclosed
WO-2023239189-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 2023-12-14 WO disclosed
US-11844273-B2 Heterocyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2023-12-12 US disclosed
US-20230389417-A1 AMINE-CONTAINING COMPOUND, LIGHT-EMITTING DEVICE INCLUDING THE SAME, ELECTRONIC DEVICE INCLUDING THE LIGHT-EMITTING DEVICE AND ELECTRONIC APPARATUS INCLUDING THE ELECTRONIC DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2023-11-30 US disclosed
CN-117105793-A Synthesis method of N1, N5-diamyl-1, 5-naphthalene diamine 台州学院 2023-11-24 CN disclosed
CN-1922236-A Method for producing polymer compound SUMITOMO CHEMICAL CO (JP) 2007-02-28 CN disclosed
EP-1721922-A1 METHOD FOR PRODUCING POLYMER COMPOUND Sumitomo Chemical Company, Limited (JP) 2006-11-15 EP disclosed
WO-2006070897-A1 ANTHRACENE DERIVATIVE, AND LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, AND ELECTRONIC APPLIANCE USING THE SAME SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2006-07-06 WO disclosed
WO-2006070907-A1 ANTHRACENE DERIVATIVE, LIGHT EMITTING ELEMENT USING THE SAME, AND LIGHT EMITTING DEVICE USING THE SAME SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2006-07-06 WO disclosed
US-7041779-B1 Rigid-rod benzobisazole polymers incorporating naphthalene-1,5-diyl structure units THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 2006-05-09 US disclosed
US-20060093857-A1 Oligonaphthalene derivatives, and light-emitting element and light-emitting device using oligonaphthalene derivatives SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2006-05-04 US disclosed
EP-1652902-A1 Oligonaphthalene derivatives, and light-emitting element and light-emitting device using oligonaphthalene derivatives SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2006-05-03 EP disclosed
EP-0550671-A1 PROCESS FOR PREPARING A PRODUCT STREAM RICH IN NAPHTHALENE AND 2-MONOIODONAPHTHALENE EASTMAN KODAK COMPANY (US) 1993-07-14 EP disclosed
WO-1992004308-A1 PROCESS FOR PREPARING A PRODUCT STREAM RICH IN NAPHTHALENE AND 2-MONOIODONAPHTHALENE EASTMAN KODAK COMPANY (US) 1992-03-19 WO disclosed
US-5026931-A Process for preparing a product stream rich in naphthalene and 2-monoiodonaphthalene EASTMAN KODAK COMPANY (US) 1991-06-25 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060093857-A1 Oligonaphthalene derivatives, and light-emitting element and light-emitting device using oligonaphthalene derivatives OCIAD1, CYBA, CRY2 NOS1 1812/4885DYRK1A 3825/4885TYMS 1987/4885
US-11844273-B2 Heterocyclic compound and organic light-emitting device including the same DDT, PPOX, LEF1 NOS1 2351/4885DYRK1A 2426/4885TYMS 1152/4885
US-20230389417-A1 AMINE-CONTAINING COMPOUND, LIGHT-EMITTING DEVICE INCLUDING THE SAME, ELECTRONIC DEVICE INCLUDING THE LIGHT-EMITTING DEVICE AND ELECTRONIC APPARATUS INCLUDING THE ELECTRONIC DEVICE SLC1A2, PNMT, SAT1 NOS1 226/4885DYRK1A 3647/4885TYMS 3473/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.