SCHEMBL865712

SCHEMBL865712

O=C(O)c1[c]cc(Cl)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.44
ALOX15 P16050 1/20 0.44
SRD5A2 P31213 1/20 0.40
ALDH1A1 P00352 2/20 0.39
TP53 P04637 1/20 0.39
CASP1 P29466 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CES2 O00748 2/20 0.36
CES1 P23141 2/20 0.36
TPMT P51580 1/20 0.34
NR4A1 P22736 1/20 0.34
F7 P08709 2/20 0.32
F3 P13726 2/20 0.32
ALAD P13716 1/20 0.32
NOTUM Q6P988 1/20 0.32
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
CYP2C9 P11712 1/20 0.32

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
SCHEMBL3607694 0.80 CES2 (0.38) TSHRALOX15ALDH1A1SMN1; SMN2CA1
SCHEMBL3609237 0.80 NPC1 (0.38) TSHRALOX15ALDH1A1CASP1SMN1; SMN2
SCHEMBL3617819 0.75 ALDH1A1 (0.40) ALOX15ALDH1A1SMN1; SMN2CYP2C9CYP2C19
SCHEMBL1196135 0.75 ABL1 (0.43) TSHRALDH1A1CASP1SMN1; SMN2HSD17B10
SCHEMBL6204341 0.75 ALDH1A1 (0.52) TSHRALOX15ALDH1A1HSD17B10
SCHEMBL2780243 0.74 TSHR (0.50) TSHRALOX15SRD5A2ALDH1A1TP53
SCHEMBL1196438 0.74 TMPRSS4 (0.50) TSHRALOX15ALDH1A1TP53SMN1; SMN2
SCHEMBL4957915 0.73 TSHR (0.48) TSHRALOX15SRD5A2ALDH1A1TP53
SCHEMBL4030667 0.73 TPMT (0.44) TSHRALOX15TP53CA1CA2
SCHEMBL16267153 0.73 ALDH1A1 (0.44) SRD5A2ALDH1A1SMN1; SMN2CES2CES1

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 167 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220153713-A1 HYDRAZONE AMIDE DERIVATIVE AND APPLICATION THEREOF IN PREPARATION OF MEDICAMENTS FOR PREVENTING AND TREATING ALOPECIA SHENZHEN CELL INSPIRE PHARMACEUTICAL DEVELOPMENT CO., LTD. (CN) 2022-05-19 US claimed
US-20220153688-A1 HYDRAZONE AMIDE DERIVATIVES AND USE THEREOF IN PREPARATION OF ANTI-OSTEOPOROSIS DRUGS SHENZHEN CELL INSPIRE PHARMACEUTICAL DEVELOPMENT CO., LTD. (CN) 2022-05-19 US claimed
EP-3992185-A1 HYDRAZONE AMIDE DERIVATIVE AND APPLICATION THEREOF IN PREPARATION OF MEDICAMENTS FOR PREVENTING AND TREATING ALOPECIA Shenzhen Cell Inspire Pharmaceutical Development Co., Ltd. (CN) 2022-05-04 EP claimed
EP-3992184-A1 HYDRAZONE AMIDE DERIVATIVES AND USE THEREOF IN PREPARATION OF ANTI-OSTEOPOROSIS DRUGS Shenzhen Cell Inspire Pharmaceutical Development Co., Ltd. (CN) 2022-05-04 EP claimed
CN-113105411-A Hydrazone amide derivatives and pharmaceutical compositions 深圳市三启药物开发有限公司 2021-07-13 CN claimed
US-8410155-B2 Arylpropionamide, arylacrylamide, arylpropynamide, or arylmethylurea analogs as factor XIA inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2013-04-02 US claimed
US-20120270853-A1 ARYLPROPIONAMIDE, ARYLACRYLAMIDE, ARYLPROPYNAMIDE, OR ARYLMETHYLUREA ANALOGS AS FACTOR XIA INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2012-10-25 US claimed
US-8252830-B2 Arylpropionamide, arylacrylamide, arylpropynamide, or arylmethylurea analogs as factor XIa inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2012-08-28 US claimed
EP-1981854-B1 ARYLPROPIONAMIDE, ARYLACRYLAMIDE, ARYLPROPYNAMIDE, OR ARYLMETHYLUREA ANALOGS AS FACTOR XIA INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2011-06-01 EP claimed
US-20110028446-A1 ARYLPROPIONAMIDE, ARYLACRYLAMIDE, ARYLPROPYNAMIDE, OR ARYLMETHYLUREA ANALOGS AS FACTOR XIA INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2011-02-03 US claimed
US-5948813-A Method of preventing allograft rejection PFIZER INC. (US) 1999-09-07 US claimed
EP-0912549-A1 COMPOUNDS AND METHODS FOR PROVIDING PHARMACOLOGICALLY ACTIVE PREPARATIONS AND USES THEREOF THE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1999-05-06 EP claimed
JP-2765757-B2 1998-06-18 JP claimed
EP-0836850-A2 Method of preventing allograft rejection PFIZER INC. (US) 1998-04-22 EP claimed
WO-1997048694-A1 COMPOUNDS AND METHODS FOR PROVIDING PHARMACOLOGICALLY ACTIVE PREPARATIONS AND USES THEREOF BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1997-12-24 WO claimed
US-5684046-A LEUKOTRIENE B4 ANTAGONIST AS ANTIINFLAMMATORY AGENTS OR ANTIARTHRITIC AGENTS PFIZER INC (US) 1997-11-04 US claimed
EP-0623123-B1 Benzopyran and related LTB4-antagonists PFIZER (US) 1997-04-23 EP claimed
US-5552435-A ANTIINFLAMMATORY AGENTS, LEUKOTRIENE B4 ANTAGONISTS PFIZER INC. (US) 1996-09-03 US claimed
EP-0623123-A1 BENZOPYRAN AND RELATED LTB4 ANTAGONISTS. PFIZER (US) 1994-11-09 EP claimed
WO-1993015067-A1 BENZOPYRAN AND RELATED LTB4 ANTAGONISTS PFIZER INC. (US) 1993-08-05 WO claimed

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

For each of this compound's patents that has machine-readable text (4 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-20120270853-A1 ARYLPROPIONAMIDE, ARYLACRYLAMIDE, ARYLPROPYNAMIDE, OR ARYLMETHYLUREA ANALOGS AS FACTOR XIA INHIBITORS TFPI, F11, F12 TSHR 1338/4885ALOX15 2971/4885SRD5A2 3840/4885
US-20220153688-A1 HYDRAZONE AMIDE DERIVATIVES AND USE THEREOF IN PREPARATION OF ANTI-OSTEOPOROSIS DRUGS SOST, HDAC5, PTH1R TSHR 1218/4885ALOX15 1854/4885SRD5A2 329/4885
US-20220153713-A1 HYDRAZONE AMIDE DERIVATIVE AND APPLICATION THEREOF IN PREPARATION OF MEDICAMENTS FOR PREVENTING AND TREATING ALOPECIA FH, HDGF, HRH4 TSHR 1288/4885ALOX15 1512/4885SRD5A2 130/4885
US-20110028446-A1 ARYLPROPIONAMIDE, ARYLACRYLAMIDE, ARYLPROPYNAMIDE, OR ARYLMETHYLUREA ANALOGS AS FACTOR XIA INHIBITORS TFPI, F11, F12 TSHR 1338/4885ALOX15 2971/4885SRD5A2 3840/4885

“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.