SCHEMBL16148795

SCHEMBL16148795

OB(O)c1ccc(Cc2ccc(F)cc2)s1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 4/20 0.41
EPHX2 P34913 1/20 0.39
TSHR P16473 1/20 0.38
ENPP2 Q13822 1/20 0.38
SMN1; SMN2 Q16637 6/20 0.37
TP53 P04637 4/20 0.37
HSD17B2 P37059 1/20 0.36
MAPT P10636 3/20 0.35
ALDH1A1 P00352 2/20 0.35
LMNA P02545 2/20 0.35
HPGD P15428 2/20 0.35
GAA P10253 1/20 0.35
PKM P14618 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
NPC1 O15118 1/20 0.35
NFKB1 P19838 1/20 0.35
RAB9A P51151 1/20 0.35
NFKB2 Q00653 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL1680761 0.76 LOXL2 (0.52) ALOX5EPHX2SMN1; SMN2TP53HSD17B2
SCHEMBL8304377 0.72 ALOX5 (0.43) ALOX5EPHX2SMN1; SMN2TP53MAPT
SCHEMBL5476883 0.72 IDO1 (0.41) ALOX5EPHX2SMN1; SMN2TP53MAPT
SCHEMBL177379 0.70 TSHR (0.48) TSHRENPP2MAPTALDH1A1HPGD
SCHEMBL29953913 0.70 TSHR (0.48) TSHRLOXL2
SCHEMBL8298518 0.69 HDAC4 (0.40) TSHRALDH1A1
SCHEMBL1680352 0.69 ALOX5 (0.42) ALOX5EPHX2SMN1; SMN2TP53HSD17B2
SCHEMBL754372 0.69 ALDH1A1 (0.45) ALOX5EPHX2TSHRSMN1; SMN2ALDH1A1
SCHEMBL6963519 0.69 TSHR (0.46) TSHRSMN1; SMN2TP53MAPTALDH1A1
SCHEMBL22609233 0.69 ORAI1 (0.52) TSHRENPP2KDM4EIDO1ORAI1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9580431-B2 Inhibitors of human immunodeficiency virus replication VIIV Healthcare UK (No.5) Limited (GB) 2017-02-28 US disclosed
US-9580431-B2 Inhibitors of human immunodeficiency virus replication VIIV Healthcare UK (No.5) Limited (GB) 2017-02-28 US disclosed
US-9580431-B2 Inhibitors of human immunodeficiency virus replication VIIV Healthcare UK (No.5) Limited (GB) 2017-02-28 US disclosed
US-20160016960-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION BRISTOL-MYERS SQUIBB COMPANY (US) 2016-01-21 US disclosed
US-20160016960-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION BRISTOL-MYERS SQUIBB COMPANY (US) 2016-01-21 US disclosed
US-20160016960-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION BRISTOL-MYERS SQUIBB COMPANY (US) 2016-01-21 US disclosed
EP-2970298-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION Bristol-Myers Squibb Company (US) 2016-01-20 EP disclosed
WO-2014164467-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION BRISTOL-MYERS SQUIBB COMPANY (US) 2014-10-09 WO disclosed
WO-2014164467-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION BRISTOL-MYERS SQUIBB COMPANY (US) 2014-10-09 WO 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-20160016960-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION EIF2AK2, RTF2, MAVS ALOX5 2602/4885EPHX2 3887/4885TSHR 4837/4885

“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.