SCHEMBL8665828

SCHEMBL8665828

Cc1cccc(N(C)C(=O)Sc2ccc3ccccc3c2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.53
▸ TDP1 Q9NUW8 2/20 0.53
▸ NR1I2 O75469 1/20 0.53
▸ CYP1A2 P05177 1/20 0.53
▸ CYP3A4 P08684 1/20 0.53
▸ MAPT P10636 1/20 0.53
▸ CYP2C9 P11712 1/20 0.53
▸ MAPK1 P28482 1/20 0.53
▸ CYP2C19 P33261 1/20 0.53
▸ HTR2B P41595 1/20 0.53
▸ CYP51A1 Q16850 1/20 0.53
▸ HSD17B1 P14061 8/20 0.45
▸ HSD17B2 P37059 8/20 0.45
▸ SIGMAR1 Q99720 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ MEN1 O00255 1/20 0.41
▸ NPC1 O15118 1/20 0.41

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
SCHEMBL20652825 0.78 LMNA (0.71) LMNATDP1NR1I2CYP1A2CYP3A4
SCHEMBL11332669 0.77 ALDH1A1 (0.50) KDM4EEPHX1
SCHEMBL11764786 0.75 ALDH1A1 (0.43) CYP1A2KDM4ESMN1; SMN2NPC1RAB9A
SCHEMBL7462682 0.73 HTR3E (0.48) TDP1MAPTHSD17B1HSD17B2SMN1; SMN2
SCHEMBL18773869 0.71 MEN1 (0.56) LMNATDP1NR1I2CYP1A2CYP3A4
SCHEMBL22852718 0.71 TERT (0.47) LMNATDP1HSD17B1HSD17B2SMN1; SMN2
SCHEMBL21870620 0.71 HSD17B1 (0.54) LMNATDP1NR1I2CYP1A2CYP3A4
SCHEMBL12048748 0.71 TDP1 (0.54) LMNATDP1NR1I2CYP1A2CYP3A4
SCHEMBL7458789 0.70 MAPT (0.45) MAPTHSD17B1HSD17B2SMN1; SMN2
SCHEMBL2088201 0.70 HSD17B1 (0.57) LMNATDP1NR1I2CYP1A2CYP3A4

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-61018716-A — — None — — JP disclosed
JP-61257920-A — — None — — JP disclosed
US-5810944-A Cleanser for surgical instruments CHEMISCHE FABRIK DR. WEIGERT (GMBH & CO.) (DE) 1998-09-22 — — US disclosed
EP-0309624-B1 COMPOSITION FOR ENHANCING PERCUTANEOUS ADMINISTRATION OF MEDICINE NITTO DENKO CORPORATION (JP) 1992-03-11 — — EP disclosed
US-5059628-A Proline or prolinol ester to enhance absorption NITTO ELECTRIC INDUSTRIAL CO., LTD. (JP) 1991-10-22 — — US disclosed
EP-0309624-A1 Composition for enhancing percutaneous administration of medicine NITTO DENKO CORPORATION (JP) 1989-04-05 — — EP disclosed
JP-S61257920-A ANTIMYCOTIC GELATINOUS AGENT FOR EXTERNAL USE SATO SEIYAKU KK 1986-11-15 — — JP disclosed
JP-S6118716-A TOLNAFTATE GEL FOR EXTERNAL USE NIPPON ZOKI PHARMACEUT CO LTD 1986-01-27 — — JP disclosed
Send feedback