SCHEMBL4170464

SCHEMBL4170464

C=CCc1cccc(C(CC=C)(CC=C)c2ccccc2)c1CC=C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
GABRA1 P14867 1/20 0.37
GABRB2 P47870 1/20 0.37
HTT P42858 1/20 0.36
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
AURKA O14965 1/20 0.30
DAPK3 O43293 1/20 0.30
MAP4K4 O95819 1/20 0.30
RET P07949 1/20 0.30
IGF1R P08069 1/20 0.30
MET P08581 1/20 0.30
PIM1 P11309 1/20 0.30
LTK P29376 1/20 0.30
KDR P35968 1/20 0.30
MAPK8 P45983 1/20 0.30
MAPK9 P45984 1/20 0.30
CDK8 P49336 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
SCHEMBL170076 0.93 ALDH1A1 (0.37) ALDH1A1TSHRGABRA1GABRB2HTT
SCHEMBL28233471 0.83 GABRA1 (0.40) ALDH1A1TSHRGABRA1GABRB2HTT
SCHEMBL28564856 0.81 ALDH1A1 (0.41) ALDH1A1TSHRGABRA1GABRB2HTT
SCHEMBL10904077 0.81 ALDH1A1 (0.37) ALDH1A1TSHRHTTKMT2A
SCHEMBL11871143 0.80 HTT (0.41) ALDH1A1TSHRHTTKMT2AMEN1
SCHEMBL170075 0.78
SCHEMBL10614506 0.76 GABRA1 (0.40) GABRA1GABRB2KMT2AMEN1AKR1B1
Hydrochloric Acid SCHEMBL10751108 0.75 GABRA1 (0.39) GABRA1GABRB2KMT2AMEN1AKR1B1
SCHEMBL7740564 0.74 TSHR (0.55) ALDH1A1TSHRHTTKMT2AMEN1
SCHEMBL11054212 0.74 GABRA1 (0.43) ALDH1A1GABRA1GABRB2KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159760-A1 ISOCYANATE-MODIFIED ASPHALT COMPOSITIONS BASF SE (DE) 2023-05-25 US claimed
EP-3707183-B1 POLYMERIC ADDITIVES FOR REDUCING THE VISCOSITY LOSS ON TINTING BASF SE (DE) 2022-01-05 EP claimed
EP-1533329-B1 Aqueous polyurethane dispersion and method for making and using same AIR PROD & CHEM (US) 2009-07-01 EP claimed
EP-4070937-B1 METHOD FOR PRODUCING FIBER-REINFORCED RESIN ARTICLE MITSUBISHI GAS CHEMICAL CO (JP) 2024-07-17 EP disclosed
WO-2023233962-A1 ADHESIVE COMPOSITION AND ARTICLE AGC株式会社 2023-12-07 WO disclosed
WO-2023228835-A1 HOT-MELT ADHESIVE SHEET 日東シンコー株式会社 2023-11-30 WO disclosed
WO-2023204068-A1 ADHESIVE COMPOSITION, CURED PRODUCT OF SAID ADHESIVE COMPOSITION, AND METHOD FOR PRODUCING SAID ADHESIVE COMPOSITION AGC株式会社 2023-10-26 WO disclosed
WO-2021132657-A1 MOISTURE-PERMEABLE WATERPROOF FABRIC 東レコーテックス株式会社 2021-07-01 WO disclosed
EP-0125342-A1 Process for preparation of aromatic polycarboxylic acids and intermediates therefor THE UPJOHN COMPANY (US) 1984-11-21 EP disclosed
US-4423200-A FROM POLYURETHANE AND CHAIN EXTENDING AROMATIC DIAMINE BAYER AKTIENGESELLSCHAFT (DE) 1983-12-27 US disclosed