SCHEMBL404433

SCHEMBL404433

Cc1ccc(-c2ccccc2)nc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.66
CYP2A6 P11509 1/20 0.66
CCR1 P32246 1/20 0.65
CCR5 P51681 1/20 0.65
CCR8 P51685 1/20 0.65
HDAC6 Q9UBN7 1/20 0.65
LDHA P00338 2/20 0.52
CYP11B1 P15538 7/20 0.51
CYP11B2 P19099 7/20 0.51
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
BAZ2B Q9UIF8 1/20 0.49
METAP2 P50579 1/20 0.47
HPGDS O60760 1/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
HPGD P15428 1/20 0.46

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
Hydrochloric Acid SCHEMBL28148510 0.98 CYP3A4 (0.63) CYP3A4CYP2A6CCR1CCR5CCR8
SCHEMBL12359222 0.96 CYP3A4 (0.61) CYP3A4CYP2A6CCR1CCR5CCR8
SCHEMBL15614084 0.94 CYP3A4 (0.65) CYP3A4CYP2A6CCR1CCR5CCR8
Pyridine SCHEMBL28163164 0.90 CYP3A4 (0.71) CYP3A4CYP2A6CCR1CCR5CCR8
SCHEMBL27890976 0.90 CYP3A4 (0.56) CYP3A4CYP2A6CCR1CCR5CCR8
SCHEMBL9974926 0.89 CYP3A4 (0.54) CYP3A4CYP2A6CCR1CCR5CCR8
SCHEMBL17051514 0.88 CCR1 (0.75) CYP3A4CYP2A6CCR1CCR5CCR8
SCHEMBL10057488 0.87 CYP3A4 (0.53) CYP3A4CYP2A6CCR1CCR5CCR8
SCHEMBL2480995 0.86 CYP3A4 (0.56) CYP3A4CYP2A6CCR1CCR5CCR8
SCHEMBL2477927 0.86 CCR1 (0.71) CYP3A4CYP2A6CCR1CCR5CCR8

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 1232 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240124770-A1 COMPOUND, GUEST MATERIAL OF LIGHT-EMITTING LAYER, ORGANIC ELECTROLUMINESCENT DEVICE, AND DISPLAY DEVICE BEIJING NORMAL UNIVERSITY (CN) 2024-04-18 US claimed
WO-2022166889-A1 COMPOUND, GUEST MATERIAL OF LIGHT-EMITTING LAYER, ORGANIC ELECTROLUMINESCENT DEVICE, AND DISPLAY DEVICE 北京师范大学 2022-08-11 WO claimed
WO-2017046813-A1 FLUORESCENT CYCLOMETALATED Ir (III) COMPLEXES AND FORMULATIONS/ COMPOSITIONS COMPRISING THE SAME GUPTA PARNA (IN) 2017-03-23 WO claimed
EP-2401275-B1 NAPHTHYRIDINE DERIVATIVES HAVING BRONCHODILATING ACTIVITY RESPIRATORIUS AB (SE) 2013-07-24 EP claimed
CN-122011044-A Organometallic compound and organic light-emitting layer material 吉林奥来德光电材料股份有限公司 2026-05-12 CN disclosed
US-20250338370-A1 HETEROLEPTIC IRIDIUM COMPLEXES AS DOPANTS UNIVERSAL DISPLAY CORPORATION (US) 2025-10-30 US disclosed
US-12439813-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPRATION (US) 2025-10-07 US disclosed
US-12408242-B2 Heteroleptic iridium complexes as dopants UNIVERSAL DISPLAY CORPORATION (US) 2025-09-02 US disclosed
US-20250250483-A1 ORGANOMETALLIC COMPLEX AND LIGHT-EMITTING DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2025-08-07 US disclosed
EP-4570317-A2 COMPOUNDS FOR THE TREATMENT OF BOVINE OR SWINE RESPIRATORY DISEASE Intervet International B.V. (NL) 2025-06-18 EP disclosed
CN-120118130-A Organic metal compound and organic electroluminescent device comprising same 吉林奥来德光电材料股份有限公司 2025-06-10 CN disclosed
CN-120058810-A Organic light-emitting doped material, preparation method thereof and organic electroluminescent device 吉林奥来德光电材料股份有限公司 2025-05-30 CN disclosed
US-5872136-A Arylheteroaryl inhibitors of farnesyl-protein transferase MERCK & CO., INC. (US) 1999-02-16 US disclosed
EP-0891361-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1999-01-20 EP disclosed
WO-1997036901-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1997-10-09 WO disclosed
EP-0484857-B1 Polyorganosiloxane having a quaternary salt at its one terminal and percutaneous absorption-promoting agent SAGAMI CHEM RES (JP) 1997-05-07 EP disclosed
US-5624680-A SKIN ABSORPTION OF DRUGS WITH POLYETHERSILOXANE BLOCK COPOLYMERS SAGAMI CHEMICAL RESEARCH CENTER (JP) 1997-04-29 US disclosed
EP-0710688-A1 HYDROXYSILYL-TERMINATED POLYOXYETHYLENE COMPOUND, QUATERNARY-SALT-TERMINATED BLOCK COPOLYMER, AND PERCUTANEOUS ABSORPTION PROMOTER SAGAMI CHEMICAL RESEARCH CENTER (JP) 1996-05-08 EP disclosed
US-5200488-A POLYORGANOSILOXANE HAVING A QUATERNARY SALT AT ITS ONE TERMINAL AND PERCUTANEOUS ABSORPTION-PROMOTING AGENT SAGAMI CHEMICAL RESEARCH CENTER (JP) 1993-04-06 US disclosed
EP-0484857-A2 Polyorganosiloxane having a quaternary salt at its one terminal and percutaneous absorption-promoting agent SAGAMI CHEMICAL RESEARCH CENTER (JP) 1992-05-13 EP 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-12408242-B2 Heteroleptic iridium complexes as dopants JUND, DRD2, DRD1 CYP3A4 1215/4885CYP2A6 2971/4885CCR1 4248/4885
US-12439813-B2 Organic electroluminescent materials and devices OCIAD2, DRD2, OPRD1 CYP3A4 1872/4885CYP2A6 3103/4885CCR1 2902/4885
US-20250338370-A1 HETEROLEPTIC IRIDIUM COMPLEXES AS DOPANTS JUND, DRD2, DRD1 CYP3A4 1215/4885CYP2A6 2971/4885CCR1 4248/4885
US-20250250483-A1 ORGANOMETALLIC COMPLEX AND LIGHT-EMITTING DEVICE CRY1, CRY2, RPS23 CYP3A4 252/4885CYP2A6 1440/4885CCR1 2568/4885

“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.