SCHEMBL39484

SCHEMBL39484

Nc1ccc(Cc2ccccc2N)cc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.56
ALDH1A1 P00352 1/20 0.56
TSHR P16473 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
HTR6 P50406 3/20 0.50
MAOB P27338 4/20 0.48
MAOA P21397 2/20 0.48
HTR2A P28223 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
GFER P55789 1/20 0.44
LOXL2 Q9Y4K0 1/20 0.42
KEAP1 Q14145 1/20 0.42
CYP17A1 P05093 1/20 0.41
CYP19A1 P11511 1/20 0.41
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
FDPS P14324 1/20 0.40

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
SCHEMBL29372857 1.00 CYP3A4 (0.56) CYP3A4ALDH1A1TSHRTDP1HTR6
SCHEMBL18203488 0.98 CYP3A4 (0.54) CYP3A4ALDH1A1TSHRTDP1HTR6
4,4'-Methylenedianiline SCHEMBL5189841 0.98 CYP3A4 (0.61) CYP3A4ALDH1A1TSHRTDP1HTR6
4,4'-Methylenedianiline SCHEMBL2877004 0.93 CYP3A4 (0.61) CYP3A4ALDH1A1TSHRTDP1HTR6
SCHEMBL10422322 0.89 CYP3A4 (0.50) CYP3A4ALDH1A1TSHRTDP1HTR6
SCHEMBL2782720 0.88 CYP3A4 (0.45) CYP3A4ALDH1A1TSHRTDP1HTR6
SCHEMBL486603 0.88 CYP3A4 (0.65) CYP3A4ALDH1A1TSHRTDP1HTR6
SCHEMBL9665442 0.87 CYP3A4 (0.48) CYP3A4ALDH1A1TSHRTDP1HTR6
SCHEMBL542553 0.86 HTR2A (0.56) CYP3A4ALDH1A1MAOBMAOAHTR2A
SCHEMBL5693811 0.83 HTR2A (0.39) CYP3A4ALDH1A1TSHRTDP1HTR6

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

Appears in 4840 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4713309-A1 PROCESS FOR THE ISOMERIZATION OF AROMATIC AMINES BASF SE (DE) 2026-03-25 EP claimed
US-20260055254-A1 NOVEL URETHANASES FOR THE ENZYMATIC DEGRADATION OF POLYURETHANES COVESTRO DEUTSCHLAND AG (DE) 2026-02-26 US claimed
US-20260015454-A1 HIGH PERFORMANCE, AMBIENT CURE POLYURETHANES COMPRISING POLYCAPROLACTONE POLYOLS INGEVITY UK LTD (GB) 2026-01-15 US claimed
US-20250243313-A1 POLYCAPROLACTONE POLYOLS, ELASTOMERS, AND METHODS OF MAKING AND USING THE SAME INGEVITY UK LTD (GB) 2025-07-31 US claimed
US-20250230274-A1 POLYCAPROLACTONE POLYOLS, POLYURETHANE DISPERSIONS, AND METHODS OF MAKING AND USING THE SAME INGEVITY UK LTD (GB) 2025-07-17 US claimed
EP-4504931-A1 NOVEL URETHANASES FOR THE ENZYMATIC DEGRADATION OF POLYURETHANES Covestro Deutschland AG (DE) 2025-02-12 EP claimed
US-20250019579-A1 COMPOSITION BASED ON (METH)ACRYLATE MONOMERS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2025-01-16 US claimed
WO-2024240631-A1 PROCESS FOR THE ISOMERIZATION OF AROMATIC AMINES BASF SE (DE) 2024-11-28 WO claimed
US-12146022-B2 Polyol components and use thereof for the production of rigid polyurethane foams BASF SE (DE) 2024-11-19 US claimed
EP-4437056-A1 COMPOSITION BASED ON (METH)ACRYLATE MONOMERS Bostik SA (FR) 2024-10-02 EP claimed
EP-0019844-B1 SURFACE-ACTIVE AGENTS, AQUEOUS ISOCYANATE EMULSIONS CONTAINING THESE SURFACE-ACTIVE AGENTS, AND THEIR USE AS BINDERS FOR MANUFACTURING MOULDED BODIES BAYER AG (DE) 1983-03-16 EP claimed
EP-0019860-B1 AQUEOUS ISOCYANATE EMULSIONS AND THEIR USE AS BINDERS IN A PROCESS FOR PRODUCING SHAPED ARTICLES BAYER AG (DE) 1982-06-16 EP claimed
EP-0019860-A1 Aqueous isocyanate emulsions and their use as binders in a process for producing shaped articles BAYER AG (DE) 1980-12-10 EP claimed
EP-0019859-A1 Use of self-releasing binders on an isocyanate-/sulfonicacid-basis for producing shaped articles BAYER AG (DE) 1980-12-10 EP claimed
EP-0019844-A1 Surface-active agents, aqueous isocyanate emulsions containing these surface-active agents, and their use as binders for manufacturing moulded bodies BAYER AG (DE) 1980-12-10 EP claimed
US-4087459-A Process for the preparation of polyamines BAYER AKTIENGESELLSCHAFT (DT) 1978-05-02 US claimed
US-4071558-A Aromatic polyamines and their preparation TEXACO DEVELOPMENT CORPORATION (US) 1978-01-31 US claimed
US-4029705-A Purification process for MDA THE UPJOHN COMPANY (US) 1977-06-14 US claimed
US-4028361-A Process for the purification of MDA THE UPJOHN COMPANY (US) 1977-06-07 US claimed
US-4008275-A Process for isolating 4,4'-diaminodiphenylmethane THE UPJOHN COMPANY (US) 1977-02-15 US claimed