SCHEMBL2024487

SCHEMBL2024487

C1=CC2Cc3ccccc3NC2C=C1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.43
GAA P10253 1/20 0.43
AR P10275 1/20 0.37
BRD4 O60885 1/20 0.35
CREBBP Q92793 1/20 0.35
TSHR P16473 2/20 0.32
IDO1 P14902 2/20 0.31
EPHX2 P34913 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL22344264 0.84 GAA (0.33) MAPTGAA
SCHEMBL13009316 0.82 MTNR1A (0.38) MAPTGAAMEN1KMT2A
SCHEMBL12496506 0.77 TNKS2 (0.38) MAPTGAAARBRD4CREBBP
SCHEMBL6312690 0.76 CHRNB2 (0.33)
SCHEMBL24611560 0.76 GAA (0.39) MAPTGAAARBRD4CREBBP
SCHEMBL6308525 0.76 CHRNB2 (0.33)
SCHEMBL7335844 0.74 PRCP (0.46) IDO1
SCHEMBL18068338 0.74 GAA (0.40) MAPTGAAARBRD4CREBBP
SCHEMBL7929256 0.73 GAA (0.42) MAPTGAAARBRD4CREBBP
SCHEMBL22361781 0.73 IDO1 (0.48) TSHRIDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210252184-A1 WATER-ABSORBING MATERIAL AND USES THEREOF 7905122 CANADA INC. (CA) 2021-08-19 US claimed
EP-3729442-A1 MOLECULE-BASED EQUATION ORIENTED REACTOR SIMULATION SYSTEM AND ITS MODEL REDUCTION Aspen Technology, Inc. (US) 2020-10-28 EP claimed
US-20190228843-A1 Molecule-Based Equation Oriented Reactor Simulation System And Its Model Reduction JPMORGAN CHASE BANK, N.A., AS ADMINISTRATIVE AGENT 2019-07-25 US claimed
EP-3436813-A1 WATER-ABSORBING MATERIAL AND USES THEREOF 7905122 Canada Inc. (CA) 2019-02-06 EP claimed
WO-2017165953-A1 WATER-ABSORBING MATERIAL AND USES THEREOF 7905122 CANADA INC. (CA) 2017-10-05 WO claimed
US-20260048169-A1 Water-Absorbing Material and Uses Thereof 7905122 CANADA INC (CA) 2026-02-19 US disclosed
US-12521466-B2 Water-absorbing material and uses thereof 7905122 CANADA INC. (CA) 2026-01-13 US disclosed
US-20250345212-A1 URINE TESTING GARMENT REHLING BARBARA (US) 2025-11-13 US disclosed
CN-112041001-B Peritoneal dialysis systems and related methods 费森尤斯医疗保健控股公司 2024-09-06 CN disclosed
EP-3762062-B1 PERITONEAL DIALYSIS SYSTEMS AND RELATED METHODS FRESENIUS MEDICAL CARE HOLDINGS INC (US) 2024-02-28 EP disclosed
US-11913884-B2 Visible light-activated dyes and methods of use thereof WILLIAM MARSH RICE UNIVERSITY (US) 2024-02-27 US disclosed
US-11877506-B2 Polycyclic aromatic compound KWANSEI GAKUIN EDUCATIONAL FOUNDATION (JP) 2024-01-16 US disclosed
US-20090054649-A1 Bridged Organosilane and Production Method Thereof KABUSHIKI KAISHA TOYOTA CHUO KENKYUSHO (JP) 2009-02-26 US disclosed
US-20070155952-A1 Blue electroluminescent polymer, method of preparing blue electroluminescent polymer, and organic electroluminescent device employing the same SAMSUNG DISPLAY CO., LTD. (KR) 2007-07-05 US disclosed
US-20070155952-A1 Blue electroluminescent polymer, method of preparing blue electroluminescent polymer, and organic electroluminescent device employing the same SAMSUNG DISPLAY CO., LTD. (KR) 2007-07-05 US disclosed
US-20070155952-A1 Blue electroluminescent polymer, method of preparing blue electroluminescent polymer, and organic electroluminescent device employing the same SAMSUNG DISPLAY CO., LTD. (KR) 2007-07-05 US disclosed
WO-2007041593-A2 ANTI-SCARRING DRUG COMBINATIONS AND USE THEREOF COMBINATORX, INCORPORATED (US) 2007-04-12 WO disclosed
EP-0785932-A1 PYRROLYL TETRAHYDROBENZOQUINOXALINE DIONES, THEIR PREPARATION AND USE AS GLUTAMATE RECEPTOR ANTAGONISTS BASF AKTIENGESELLSCHAFT (DE) 1997-07-30 EP disclosed
US-5576432-A Process for the manufacture of dihydropyrimidines EASTMAN KODAK COMPANY (US) 1996-11-19 US disclosed
WO-1996011922-A1 PYRROLYL TETRAHYDROBENZOQUINOXALINE DIONES, THEIR PREPARATION AND USE AS GLUTAMATE RECEPTOR ANTAGONISTS BASF AKTIENGESELLSCHAFT (DE) 1996-04-25 WO 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 (4 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-11877506-B2 Polycyclic aromatic compound F11, C1R, RNF31 MAPT 4416/4885GAA 4700/4885AR 458/4885
US-20090054649-A1 Bridged Organosilane and Production Method Thereof C5, CCNE1, QSOX1 MAPT 3900/4885GAA 2452/4885AR 4738/4885
US-20260048169-A1 Water-Absorbing Material and Uses Thereof HCN4, KCNN1, SLC9A1 MAPT 1010/4885GAA 1906/4885AR 1373/4885
US-11913884-B2 Visible light-activated dyes and methods of use thereof HCCS, CLTB, ALDH1A2 MAPT 2009/4885GAA 592/4885AR 4279/4885

“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.