SCHEMBL16211069

SCHEMBL16211069

Cc1ccc(-c2cccc(-c3ccc(C)cc3)c2C(=O)O)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
FOLH1 Q04609 2/20 0.46
KDM4E B2RXH2 2/20 0.45
LDHA P00338 1/20 0.44
LDHB P07195 1/20 0.44
AKR1C3 P42330 1/20 0.44
KMT2A Q03164 5/20 0.43
NPC1 O15118 4/20 0.43
RAB9A P51151 3/20 0.43
USP2 O75604 1/20 0.43
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
MCL1 Q07820 1/20 0.43
GAA P10253 1/20 0.43
MEN1 O00255 4/20 0.43
DHODH Q02127 1/20 0.42
LMNA P02545 2/20 0.42
SRD5A2 P31213 1/20 0.42
CES2 O00748 1/20 0.42

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
SCHEMBL22703438 0.90 TDP1 (0.46) ALDH1A1SMN1; SMN2FOLH1KDM4ELDHA
SCHEMBL7930737 0.87 MEN1 (0.50) FOLH1KMT2ANPC1RAB9AMEN1
SCHEMBL23354313 0.87 KMT2A (0.50) ALDH1A1FOLH1KMT2AMEN1DHODH
SCHEMBL23911685 0.87 FOLH1 (0.52) FOLH1KMT2ARAB9AHSD17B10MEN1
SCHEMBL3901924 0.84 CA12 (0.62) ALDH1A1SMN1; SMN2KDM4EKMT2ANPC1
SCHEMBL14825546 0.83 ABCB1 (0.46) ALDH1A1SMN1; SMN2KMT2ANPC1RAB9A
SCHEMBL593127 0.82 FOLH1 (0.61) ALDH1A1SMN1; SMN2FOLH1KMT2AHPGD
SCHEMBL593809 0.81 FOLH1 (0.49) FOLH1LDHALDHBKMT2ADHODH
SCHEMBL867477 0.81 MYC (0.47) ALDH1A1SMN1; SMN2KDM4EAKR1C3KMT2A
SCHEMBL4621115 0.80 LDHA (0.46) ALDH1A1SMN1; SMN2KDM4ELDHALDHB

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-20140330018-A1 METATHESIS CATALYSTS AND METHODS THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2014-11-06 US disclosed
US-20140330018-A1 METATHESIS CATALYSTS AND METHODS THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2014-11-06 US disclosed
US-20140330018-A1 METATHESIS CATALYSTS AND METHODS THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2014-11-06 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140330018-A1 METATHESIS CATALYSTS AND METHODS THEREOF TERT, CYP19A1, MPO ALDH1A1 109/4885SMN1; SMN2 1606/4885FOLH1 2253/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.