Sugi Predict

Sugi Predict / Compounds / SCHEMBL8936346

SCHEMBL8936346

SCHEMBL8936346

CC(C)c1ccccc1N(c1ccccc1)c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3C(C)C)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 2/20 0.36
▸ CYP3A4 P08684 2/20 0.36
▸ GABRA1 P14867 2/20 0.36
▸ GABRB2 P47870 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ CA1 P00915 2/20 0.33
▸ CA2 P00918 2/20 0.33
▸ FAAH O00519 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ GABRB1 P18505 1/20 0.33
▸ GABRG2 P18507 1/20 0.33

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
SCHEMBL21913733 0.92 GABRA1 (0.41) CYP1A2CYP3A4GABRA1GABRB2ALDH1A1
SCHEMBL6933727 0.86 CYP3A4 (0.57) CYP1A2CYP3A4GABRA1GABRB2ALDH1A1
SCHEMBL8531953 0.84 TSHR (0.46) CYP1A2CYP3A4ALDH1A1L3MBTL1KDM4E
SCHEMBL9760797 0.82 ALDH1A1 (0.43) ALDH1A1MAPTLMNAHPGDTSHR
Benzyl Alcohol SCHEMBL28300920 0.80 TSHR (0.45) GABRA1GABRB2ALDH1A1TSHRGABRG2
SCHEMBL7247455 0.80 ALDH1A1 (0.48) CYP1A2CYP3A4ALDH1A1L3MBTL1KDM4E
SCHEMBL13385198 0.78 GABRA1 (0.38) CYP1A2CYP3A4GABRA1GABRB2ALDH1A1
SCHEMBL13377362 0.78 GABRA1 (0.38) CYP1A2CYP3A4GABRA1GABRB2ALDH1A1
SCHEMBL19847573 0.78 CA1 (0.36) CYP1A2CYP3A4ALDH1A1L3MBTL1KDM4E
SCHEMBL17844313 0.78 ALDH1A1 (0.46) CYP1A2CYP3A4ALDH1A1L3MBTL1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0486038-B1 Electrophotographic photoreceptor IDEMITSU KOSAN CO (JP) 1996-10-16 — — EP claimed
US-5213924-A Copolymers, improved mechanical strength, hardness IDEMITSU KOSAN CO. LTD. (JP) 1993-05-25 — — US claimed
US-5589493-A FUNGICIDES BASF AKTIENGESELLSCHAFT (DE) 1996-12-31 — — US disclosed
US-5561017-A A CHARGE TRANSFER COMPOUND AND/OR BINDER COMPRISING A POLYESTER OR -CARBONATE OF AN ARYL HYDRAZONE MONOMER; ELECTROGRAPHY; PLATES; WEAR RESISTANCE IDEMITSU KOSAN CO., LTD. (JP) 1996-10-01 — — US disclosed
US-5556988-A Anilide derivatives and their use for combating botrytis BASF AKTIENGESELLSCHAFT (DE) 1996-09-17 — — US disclosed
US-5521041-A IMPROVED DURABILITY, NONCLOUDY, FLUORINE CONTAINING END GROUPS IDEMITSU KOSAN CO., LTD. (JP) 1996-05-28 — — US disclosed
US-5506331-A POLYESTER OR POLYCARBONATE HAVING HYDRAZONE STRUCTURE IN REPEATING UNITS, USABLE AS CHARGE TRANSPORT MATERIAL OR BINDER RESIN IN CHARGE TRANSPORT LAYER IDEMITSU KOSAN CO., LTD. (JP) 1996-04-09 — — US disclosed
US-5480897-A FUNGICIDES FOR PLANTS BASF AKTIENGESELLSCHAFT (DE) 1996-01-02 — — US disclosed
US-5330995-A Fungicides BASF AKTIENGESELLSCHAFT (DE) 1994-07-19 — — US disclosed
US-5213924-A Copolymers, improved mechanical strength, hardness IDEMITSU KOSAN CO. LTD. (JP) 1993-05-25 — — US disclosed
US-4985326-A PHOTOSENSITIVE LAYER CONTAINING A POLYCARBONATE AS BINDER RESIN IDEMITSU KOSAN CO., LTD. (JP) 1991-01-15 — — US disclosed
US-4314012-A Photoconductive reflex exposure member XEROX CORPORATION (US) 1982-02-02 — — US disclosed