SCHEMBL11710027

SCHEMBL11710027

O=C(O)c1ccccc1CCCCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.61
BID P55957 1/20 0.58
BCL2L1 Q07817 1/20 0.58
MCL1 Q07820 1/20 0.58
BAK1 Q16611 1/20 0.58
MAPT P10636 1/20 0.53
RXFP1 Q9HBX9 1/20 0.53
SLC16A3 O15427 7/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
HDAC3 O15379 1/20 0.52
MAPK1 P28482 1/20 0.52
ADRA1A P35348 1/20 0.52
HDAC4 P56524 1/20 0.52
SLC6A3 Q01959 1/20 0.52
HDAC1 Q13547 1/20 0.52
HDAC7 Q8WUI4 1/20 0.52
HDAC2 Q92769 1/20 0.52
HDAC10 Q969S8 1/20 0.52
HDAC11 Q96DB2 1/20 0.52
HDAC8 Q9BY41 1/20 0.52

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
SCHEMBL20162476 0.96 FOLH1 (0.61) FOLH1BIDBCL2L1MCL1BAK1
SCHEMBL729909 0.92 FOLH1 (0.70) FOLH1BIDBCL2L1MCL1BAK1
SCHEMBL9345842 0.90 FOLH1 (0.68) FOLH1BIDBCL2L1MCL1BAK1
SCHEMBL10641089 0.90 TSHR (0.68) FOLH1MAPTSLC16A3ALDH1A1TSHR
SCHEMBL8698803 0.89 FOLH1 (0.58) FOLH1BIDBCL2L1MCL1BAK1
SCHEMBL29975597 0.88 FOLH1 (0.66) FOLH1MAPTSMN1; SMN2ALDH1A1TSHR
SCHEMBL166927 0.88 FOLH1 (0.66) FOLH1MAPTSMN1; SMN2ALDH1A1TSHR
SCHEMBL31474045 0.88 FOLH1 (0.70) FOLH1SLC16A3SMN1; SMN2ALDH1A1TSHR
Hydrochloric Acid SCHEMBL7699238 0.86 FOLH1 (0.63) FOLH1MAPTSMN1; SMN2ALDH1A1TSHR
SCHEMBL8702953 0.86 FOLH1 (0.63) FOLH1MAPTSMN1; SMN2ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4054579-A Intermediates in the process for the preparation of 2-(5H-dibenzo[a,d]cyclohepten-5-on-2-yl)acetic, propionic and butyric acids SYNTEX (U.S.A.) INC. (US) 1977-10-18 US disclosed
US-4011243-A Intermediate in the oxidative process for the preparation of 2-(5H-dibenzo[a,d]cyclohepten-5-on-2-yl)acetic, propionic and butyric acids SYNTEX (U.S.A.) INC. (US) 1977-03-08 US disclosed
US-3979430-A Solvolytic process for the preparation of 2-(5H-dibenzo[a,d]cyclohepten-5-on-2-yl)acetic, propionic and butyric acids SYNTEX (U.S.A.) INC. (US) 1976-09-07 US disclosed